In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 13 | Yes |
Popular Name: 1-[(4aR,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]-2-amino-ethanone 1-[(4aR,7aS)-3,4a,5,6,7,7a-hexah…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.80 | 0.2 | -48.04 | 3 | 4 | 1 | 57 | 185.247 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.80 | -0.2 | -8.05 | 2 | 4 | 0 | 56 | 184.239 | 1 | ↓ |